16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=4002.1057994288217 pbc="F F F" Lu -0.20749249 -0.09768980 -0.11300950 71 -98.92489378 -112.55655554 -195.91997199 Lu 1.41783889 1.27890749 1.74206864 71 811.32264556 -1730.79776896 -3169.45579776 Lu 2.99652815 -0.26005074 0.27139051 71 -98.52855004 -667.14002679 -681.86047638 Lu 4.36928470 1.41088073 1.61721276 71 3661.64189899 -2284.26139932 199.67389132 Lu -0.07474166 2.92987105 0.16312152 71 -621.28324162 -377.14295371 -1001.24783782 Lu 1.25291764 4.69498043 1.31566321 71 564.60526383 1015.91836469 97.81342580 Lu 3.20352792 2.75882014 0.19148261 71 -1449.69756184 1323.82512951 -2304.29156424 Lu 4.58331035 4.56500635 1.41143073 71 351.50602788 459.91798759 160.65964985 Lu -0.25215340 -0.15470552 2.78792924 71 -967.07980401 -873.60147089 360.81852455 Lu 1.17502655 1.22581903 4.57544766 71 -43.85441549 66.03279778 895.12248023 Lu 2.87533207 -0.06714855 3.05430318 71 791.46905794 -1666.20787289 1071.30052827 Lu 4.49022699 1.69522226 4.60584559 71 532.40166984 -631.12690818 631.20754010 Lu 0.15789295 2.82972780 2.73785917 71 -2550.90919162 2319.83361930 1999.93023775 Lu 1.66812006 4.41949378 4.49689760 71 -221.09253736 294.02786322 282.96477350 Lu 2.97150883 2.71393936 2.88408648 71 -919.40462209 2349.85155022 1516.18904524 Lu 4.45902084 4.31339018 4.59814895 71 257.82825383 513.42764398 137.09555158